| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2c3cc1nc(NC)nc1cc3N=C(NCC)N2 |
| InChI | InChI | 1.03 | InChI=1S/C12H14N6O/c1-3-14-12-15-7-5-9-8(16-11(13-2)17-9)4-6(7)10(19)18-12/h4-5H,3H2,1-2H3,(H2,13,16,17)(H2,14,15,18,19) |
| InChIKey | InChI | 1.03 | SJNDGKATIKMROA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCNC1=Nc2cc3[nH]c(NC)nc3cc2C(=O)N1 |
| SMILES | CACTVS | 3.370 | CCNC1=Nc2cc3[nH]c(NC)nc3cc2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCNC1=Nc2cc3c(cc2C(=O)N1)nc([nH]3)NC |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCNC1=Nc2cc3c(cc2C(=O)N1)nc([nH]3)NC |
